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CAS 120511-74-2 manufacturers and suppliers on PharmaCompass

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CAS 120511-74-2
Also known as: 120511-74-2, 3,5-bis(cyanomethyl)toluene, 2,2'-(5-methyl-1,3-phenylene)diacetonitrile, 2-[3-(cyanomethyl)-5-methylphenyl]acetonitrile, 3-cyanomethyl-5-methyl-phenylacetonitrile, 5-methylbenzene-1,3-diacetonitrile
Molecular Formula
C11H10N2
Molecular Weight
170.21  g/mol
InChI Key
XJCXEUYJQHPEAE-UHFFFAOYSA-N

1 2D Structure

CAS 120511-74-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[3-(cyanomethyl)-5-methylphenyl]acetonitrile
2.1.2 InChI
InChI=1S/C11H10N2/c1-9-6-10(2-4-12)8-11(7-9)3-5-13/h6-8H,2-3H2,1H3
2.1.3 InChI Key
XJCXEUYJQHPEAE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC(=CC(=C1)CC#N)CC#N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 120511-74-2

2. 3,5-bis(cyanomethyl)toluene

3. 2,2'-(5-methyl-1,3-phenylene)diacetonitrile

4. 2-[3-(cyanomethyl)-5-methylphenyl]acetonitrile

5. 3-cyanomethyl-5-methyl-phenylacetonitrile

6. 5-methylbenzene-1,3-diacetonitrile

7. (3-cyanomethyl-5-methylphenyl)acetonitrile

8. Drofeninehydrochloride

9. Amy198

10. Schembl2262582

11. Dtxsid20923444

12. 1,3-biscyanomethyl-5-methylbenzene

13. Bcp27845

14. Mfcd07782113

15. Zinc21297549

16. Akos006285190

17. Ac-6805

18. As-13105

19. Db-021966

20. Cs-0181823

21. Ft-0642940

22. M2934

23. 2-[3-(cyanomethyl)-5-methyl-phenyl]ethanenitrile

24. 511b742

25. A804527

26. Q-100985

27. 2,2'-(5-methyl-1,3-phenylene)diacetonitrile (anastrozole Impurity)

2.3 Create Date
2007-12-04
3 Chemical and Physical Properties
Molecular Weight 170.21 g/mol
Molecular Formula C11H10N2
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass170.084398327 g/mol
Monoisotopic Mass170.084398327 g/mol
Topological Polar Surface Area47.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity226
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Flag India
Digital Content Digital Content
URL Supplier Web Content
120511-72-0
Anastrozole
Innovassynth Technologies (I) Ltd. formerly known as Chemicals Division of Indian Organic Chemicals Ltd. ...
Innovassynth Technologies (I) Ltd. formerly known as Chemicals Division of Indian Organic Chemicals Ltd. came in to existence since 1st August 2002. It is a part of the well-known business group involved in activities like polyester fiber, polymers, pre-forms, and computer software among others. The company is catering to the needs of customers in the area of 'knowledge based R & D services' for the last 5 years, which include: Contract R & D, Custom Synthesis and Contract Manufacture In a very short period the company has established its name as a reliable partner in above area of activities and has joined hands with many prestigious companies in the field. The company has identified NUCLEOSIDES as a niche area and earned reputation as a supplier of various protected Nucleosides and a partner for Process research. The company is involved in business with well-known companies in various fields like pharmaceuticals, perfumes, agro chemicals, and fine and specialty chemicals. With two sites at its disposal, one already active at Khopoli near Mumbai and the other in the development stage at Chennai. It has already set up a cGMP Pilot Plant Facility where 10-15 Kg batch size is possible. It is going for US FDA approval in near future.
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Digital Content Digital Content
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120511-84-4
Anastrozole
Innovassynth Technologies (I) Ltd. formerly known as Chemicals Division of Indian Organic Chemicals Ltd. ...
Innovassynth Technologies (I) Ltd. formerly known as Chemicals Division of Indian Organic Chemicals Ltd. came in to existence since 1st August 2002. It is a part of the well-known business group involved in activities like polyester fiber, polymers, pre-forms, and computer software among others. The company is catering to the needs of customers in the area of 'knowledge based R & D services' for the last 5 years, which include: Contract R & D, Custom Synthesis and Contract Manufacture In a very short period the company has established its name as a reliable partner in above area of activities and has joined hands with many prestigious companies in the field. The company has identified NUCLEOSIDES as a niche area and earned reputation as a supplier of various protected Nucleosides and a partner for Process research. The company is involved in business with well-known companies in various fields like pharmaceuticals, perfumes, agro chemicals, and fine and specialty chemicals. With two sites at its disposal, one already active at Khopoli near Mumbai and the other in the development stage at Chennai. It has already set up a cGMP Pilot Plant Facility where 10-15 Kg batch size is possible. It is going for US FDA approval in near future.
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